%chk=000154816.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154816

0 1
 O   0.9446000      -2.297600     -0.1774000    
 O   -4.924000      0.2278000     -0.7277000    
 O   -2.750100       2.713600      0.5809000    
 O    5.600300       2.189200      -1.026400    
 O   -5.349200     -0.4351000       1.453600    
 N   -3.688300      0.7495000     -0.2697000    
 N    5.773100      0.3577000      0.4482000    
 C   -2.495500     -3.5200000E-02 -0.2453000    
 C  -0.1918000      -1.549000     -0.2007000    
 C    2.149800      -1.633800     -2.0300001E-02
 C   -2.337600      -1.033000      -1.183700    
 C   -1.542900      0.2327000      0.7144000    
 C   -1.172000      -1.798900      -1.161200    
 C  -0.3772000     -0.5331000      0.7370000    
 C    4.558400     -0.3103000      0.2901000    
 C    2.388900     -0.4882000     -0.7577000    
 C    3.083800      -2.134700      0.8682000    
 C    3.603700      0.1792000     -0.6011000    
 C    4.298600      -1.467200       1.024800    
 C   -3.710700       2.071900      0.1537000    
 C   -5.054800       2.763100      6.3600004E-02
 C    6.209400       1.523700     -0.1952000    
 C   -5.662000     -0.3484000      0.2736000    
 C    7.591300       1.926800      0.2546000    
 C   -6.945600     -0.8707000     -0.2965000    
 H   -3.090000      -1.235000      -1.940100    
 H   -1.669400      0.9591000       1.508400    
 H   -1.032500      -2.588100      -1.894900    
 H   0.3526000     -0.3420000       1.519600    
 H    1.671100     -0.1017000      -1.475400    
 H    2.882600      -3.035200       1.440700    
 H    3.735200       1.064100      -1.208000    
 H    5.033400      -1.859900       1.723300    
 H    6.415800     -6.2199999E-02   1.116600    
 H   -4.920200       3.836700      0.2295000    
 H   -5.728100       2.379500      0.8337000    
 H   -5.496600       2.632100     -0.9279000    
 H    8.298600       1.117600      5.1700000E-02
 H    7.911400       2.821000     -0.2872000    
 H    7.581900       2.144300       1.326300    
 H   -6.733100      -1.625200      -1.058000    
 H   -7.524700     -4.6599999E-02 -0.7209000    
 H   -7.533300      -1.335900      0.5001000    


%chk=000154816-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000154816

0 1
O 0.890876 -1.844623 -0.297565
O -5.145918 0.143893 -0.675298
O -3.425694 3.092861 0.500844
O 6.219118 2.161952 -0.669583
O -5.524602 -0.458505 1.584391
N -4.033417 0.969175 -0.208642
N 6.169066 0.084187 0.424392
C -2.762653 0.300327 -0.222345
C -0.283597 -1.053545 -0.278662
C 2.169211 -1.261837 -0.095388
C -2.599350 -0.861945 -1.020963
C -1.671562 0.781259 0.549355
C -1.365778 -1.538465 -1.043551
C -0.436241 0.104275 0.517681
C 4.818114 -0.325389 0.221818
C 2.547322 -0.015361 -0.643343
C 3.109048 -2.050405 0.602422
C 3.865717 0.458332 -0.484730
C 4.426940 -1.582756 0.756748
C -4.340151 2.299466 0.136802
C -5.803816 2.699130 0.038824
C 6.799798 1.254710 -0.002950
C -5.804711 -0.600263 0.389289
C 8.269560 1.368612 0.398955
C -6.820117 -1.517430 -0.246440
H -3.429981 -1.226157 -1.630596
H -1.789821 1.679634 1.155328
H -1.226348 -2.436623 -1.651930
H 0.394700 0.474477 1.125445
H 1.822440 0.584145 -1.202826
H 2.797893 -3.016767 1.009008
H 4.171059 1.418249 -0.904344
H 5.155054 -2.199137 1.299598
H 6.747424 -0.571281 0.954208
H -5.860283 3.786046 0.196677
H -6.400402 2.197397 0.822317
H -6.236994 2.439137 -0.941460
H 8.651014 0.502002 0.967006
H 8.880194 1.492889 -0.511842
H 8.404252 2.279234 1.007877
H -6.375056 -2.523452 -0.356356
H -7.117842 -1.158875 -1.243216
H -7.699567 -1.605975 0.410346


